Chem
J-GLOBAL ID：201607017321241986
Nikkaji number：J3.511.466A
L-Lys-L-Cys-L-Cys-L-Tyr-L-Ser-L-Leu-OH
L-Lys-L-Cys-L-Cys-L-Tyr-L-Ser-L-Leu-OH
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Molecular formula： C30H49N7O9S2
Molecular formula furigana： C30-H49-N7-O9-S2
Molecular weight： 715.880
InChI：
InChI=1S/C30H49N7O9S2/c1-16(2)11-21(30(45)46)34-27(42)22(13-38)35-26(41)20(12-17-6-8-18(39)9-7-17)33-28(43)24(15-48)37-29(44)23(14-47)36-25(40)19(32)5-3-4-10-31/h6-9,16,19-24,38-39,47-48H,3-5,10-15,31-32H2,1-2H3,(H,33,43)(H,34,42)(H,35,41)(H,36,40)(H,37,44)(H,45,46)/t19-,20-,21-,22-,23-,24-/m0/s1
InChI key：
WPZPUDYAMRTIGH-BTNSXGMBSA-N
SMILES：
CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CS)NC(=O)[C@H](CS)NC(=O)[C@@H](N)CCCCN)C(=O)O
Systematic name (3)：
- L-Lys-L-Cys-L-Cys-L-Tyr-L-Ser-L-Leu-OH
- (2S)-2-[(2S)-2-[(2S)-2-[(2R)-2-[(2R)-2-[(2S)-2,6-ジアミノヘキサンアミド]-3-スルファニルプロパンアミド]-3-スルファニルプロパンアミド]-3-(4-ヒドロキシフェニル)プロパンアミド]-3-ヒドロキシプロパンアミド]-4-メチルペンタン酸
- (2S)-2-[(2S)-2-[(2S)-2-[(2R)-2-[(2R)-2-[(2S)-2,6-diaminohexanamido]-3-sulfanylpropanamido]-3-sulfanylpropanamido]-3-(4-hydroxyphenyl)propanamido]-3-hydroxypropanamido]-4-methylpentanoic acid
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